Chemical Properties of Glycine, N-methyl-N-methoxycarbonyl-, octyl ester

InChI

InChI=1S/C13H25NO4/c1-4-5-6-7-8-9-10-18-12(15)11-14(2)13(16)17-3/h4-11H2,1-3H3

InChI Key

VXHZSGDBUOYAPZ-UHFFFAOYSA-N

Formula

C13H25NO4

SMILES

CCCCCCCCOC(=O)CN(C)C(=O)OC

Molecular Weight¹

259.34

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.8175		Relay (1.0) Calculated Property
ΔfG°	-298.48	kJ/mol	Joback Calculated Property
ΔfH°gas	-873.20	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	38.02	kJ/mol	Joback Calculated Property
ΔvapH°	85.54	kJ/mol	Relay (1.0) Calculated Property
IE	8.95	eV	Relay (1.0) Calculated Property
log10WS	-2.83		Relay (1.0) Calculated Property
logPoct/wat	2.588		Crippen Calculated Property
McVol	218.890	ml/mol	McGowan Calculated Property
Pc	1771.36	kPa	Joback Calculated Property
Inp	[1726.00; 1726.00]
Inp	1726.00		NIST
Inp	1726.00		NIST
Tboil	564.11	K	Relay (1.0) Calculated Property
Tc	742.25	K	Relay (1.0) Calculated Property
Tfus	267.69	K	Relay (1.0) Calculated Property
Vc	0.843	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[607.70; 689.49]	J/mol×K	[661.86; 837.37]
Cp,gas	607.70	J/mol×K	661.86	Joback Calculated Property
Cp,gas	623.13	J/mol×K	691.11	Joback Calculated Property
Cp,gas	637.83	J/mol×K	720.36	Joback Calculated Property
Cp,gas	651.80	J/mol×K	749.62	Joback Calculated Property
Cp,gas	665.07	J/mol×K	778.87	Joback Calculated Property
Cp,gas	677.63	J/mol×K	808.12	Joback Calculated Property
Cp,gas	689.49	J/mol×K	837.37	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glycine, N-methyl-N-methoxycarbonyl-, octyl ester.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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